-
Name
Fenestrel
- EINECS
- CAS No. 7698-97-7
- Density 1.054 g/cm3
- Solubility
- Melting Point 160.5°C
- Formula C16H20O2
- Boiling Point 389.1 °C at 760 mmHg
- Molecular Weight 244.334
- Flash Point 183.3 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 2-Methyl-3-ethyl-4-phenylcyclohex-4-enecarboxylicacid;5-Ethyl-6-methyl-4-phenyl-3-cyclohexene-1-carboxylic acid;Fenestrel;ORF3858;
- PSA 37.30000
- LogP 3.83680
Fenestrel Specification
The Fenestrel ,its cas register number is 7698-97-7. The IPUAC name about this chemicals is 5-Ethyl-6-methyl-4-phenylcyclohex-3-ene-1-carboxylic acid .It has a related number is 16550-39-3 (hydrochloride salt). The index of refraction about it is 1.532, molar refractivity is 71.85 cm3 , molar volume is 231.7 cm3 and surface tension is 37.8 dyne/cm. also, it have other chemical properties, for example, the enthalpy of vaporization about this chemicals is 67.33 kJ/mol, vapour pressure is 9.44E-07 mmHg at 25°C and so on. Following are classification code about this chemicals: Estrogen ,Reproductive Effect and Tumor data.
The Fenestrel is a kind of estrogen and progesterone medicine.
This chemicals can be described computed from structure:
1) Canonical SMILES: CCC1C(C(CC=C1C2=CC=CC=C2)C(=O)O)C
2) InChI: InChI=1S/C16H20O2/c1-3-13-11(2)14(16(17)18)9-10-15(13)12-7-5-4-6-8-12/h4-8,10-11,13-14H,3,9H2,1-2H3,(H,17,18)
3) InChIKey: CLMFEXDZPBGYQQ-UHFFFAOYSA-N
The most important thing about Fenestrel is the toxicity, following is the form:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| dog | LDLo | intravenous | 20mg/kg (20mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Toxicology and Applied Pharmacology. Vol. 19, Pg. 412, 1971. |
| mouse | LD50 | intraperitoneal | 150mg/kg (150mg/kg) | Toxicology and Applied Pharmacology. Vol. 19, Pg. 412, 1971. | |
| mouse | LD50 | oral | 680mg/kg (680mg/kg) | Toxicology and Applied Pharmacology. Vol. 19, Pg. 412, 1971. | |
| rat | LD50 | oral | 2350mg/kg (2350mg/kg) | Toxicology and Applied Pharmacology. Vol. 19, Pg. 412, 1971. |
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View